%chk=000086292.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086292

0 1
 O    4.991200     -0.5810000     -0.7420000    
 O   -4.635500     -0.1140000       1.165500    
 O  -0.1856000      -4.202300     -0.5119000    
 C    1.258600      -2.365400     -0.4073000    
 C   -1.271100      -2.222900      9.9699996E-02
 C  -4.9500000E-02  -2.990300     -0.2885000    
 C    3.767000      -1.165800     -0.6334000    
 C   -3.521100     -0.8110000      0.8127000    
 C    5.674500       1.608300     -2.4300000E-02
 C   -5.990000       1.333000     -0.1935000    
 C    5.381600      0.2868000      0.2641000    
 C   -4.848100       1.111300      0.5563000    
 C    2.366700      -3.129600     -0.7727000    
 C   -1.590400      -2.123800       1.434000    
 C    1.404500      -1.001400     -0.1549000    
 C   -2.028300      -1.646500     -0.8935000    
 C    3.621000      -2.529800     -0.8856000    
 C   -2.731600      -1.407800       1.795500    
 C    2.658800     -0.4016000     -0.2681000    
 C   -3.169400     -0.9304000     -0.5319000    
 C    5.586400       2.136000      -1.379200    
 C   -7.003100      0.3015000     -0.3722000    
 C    6.065000       2.461000       1.008300    
 C   -6.179000       2.576600     -0.7961000    
 C    5.467400     -0.2087000       1.554400    
 C   -3.888600       2.096100      0.7221000    
 C    6.156700       1.978700       2.314000    
 C   -5.222900       3.580100     -0.6395000    
 C    5.858000      0.6439000       2.587000    
 C   -4.077600       3.339800      0.1196000    
 C    6.806200       2.058600      -2.278000    
 C   -8.153400      0.2232000      0.6138000    
 C    4.445500       2.682400      -1.874100    
 C   -6.964000     -0.5854000      -1.400300    
 H    2.280100      -4.194000     -0.9743000    
 H  -0.9786000      -2.587000       2.202100    
 H   0.5689000     -0.3690000      0.1296000    
 H   -1.759400      -1.739700      -1.941300    
 H    4.481000      -3.130100      -1.169800    
 H   -3.000500      -1.318300       2.844500    
 H    2.737400      0.6643000     -7.6099999E-02
 H   -3.768800     -0.4880000      -1.321800    
 H    6.302600       3.504200      0.8134000    
 H   -7.066300       2.781700      -1.390800    
 H    5.249200      -1.248400       1.780500    
 H   -2.997400       1.927500       1.319800    
 H    6.461600       2.642100       3.118000    
 H   -5.370300       4.548900      -1.107900    
 H    5.931900      0.2679000       3.603200    
 H   -3.334500       4.122000      0.2436000    
 H    6.617400       2.475600      -3.272900    
 H    7.638200       2.616300      -1.835100    
 H    7.116500       1.016200      -2.407000    
 H   -8.853000     -0.5846000      0.3742000    
 H   -7.772800      4.5400001E-02   1.625200    
 H   -8.716400       1.162600      0.6149000    
 H    3.548100       2.757800      -1.268300    
 H    4.393800       3.065100      -2.888000    
 H   -6.166700     -0.5603000      -2.136200    
 H   -7.729000      -1.345000      -1.522800    


%chk=000086292-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000086292

0 1
O 5.125775 -0.541198 -0.464545
O -5.070649 -0.431930 0.980721
O 0.011138 -4.283107 0.462192
C 1.315790 -2.286785 0.178671
C -1.262872 -2.249567 0.562871
C 0.020475 -3.008976 0.404033
C 3.851713 -1.077826 -0.184623
C -3.775487 -0.969427 0.828461
C 5.984728 1.754576 -0.469545
C -6.273259 1.297173 -0.276042
C 5.605405 0.593123 0.257880
C -5.310979 0.949858 0.711580
C 2.365632 -2.982654 -0.484711
C -2.323365 -2.869314 1.282316
C 1.572912 -0.977481 0.667379
C -1.501441 -0.985823 -0.042565
C 3.620343 -2.385523 -0.678305
C -3.566728 -2.236085 1.428043
C 2.833302 -0.369481 0.496754
C -2.750514 -0.344163 0.078925
C 5.876838 1.873244 -1.961157
C -7.033664 0.289592 -1.086733
C 6.503975 2.841992 0.289987
C -6.512569 2.687720 -0.472256
C 5.745983 0.504524 1.660010
C -4.631203 1.924149 1.474464
C 6.637328 2.776920 1.692875
C -5.831987 3.675268 0.270371
C 6.262128 1.600231 2.382560
C -4.889725 3.292892 1.253679
C 6.484861 0.772444 -2.815267
C -7.745417 -0.834623 -0.351695
C 5.303801 2.978252 -2.516316
C -7.125344 0.434101 -2.438884
H 2.171113 -4.002414 -0.831914
H -2.143938 -3.857936 1.716896
H 0.794614 -0.437430 1.215979
H -0.722428 -0.517153 -0.652377
H 4.430349 -2.906966 -1.196635
H -4.383221 -2.697019 1.991465
H 3.019735 0.636257 0.883892
H -2.930636 0.615713 -0.413373
H 6.822727 3.739824 -0.250272
H -7.264698 2.979600 -1.212964
H 5.450976 -0.418254 2.170065
H -3.908539 1.602102 2.231334
H 7.046077 3.631319 2.242654
H -6.046126 4.734812 0.094741
H 6.377872 1.530459 3.469273
H -4.367889 4.049374 1.849231
H 6.393439 1.011027 -3.888579
H 7.557876 0.642380 -2.576466
H 5.994339 -0.196377 -2.620534
H -8.311866 -1.468170 -1.055245
H -7.026509 -1.464911 0.198667
H -8.451520 -0.425178 0.396078
H 4.853451 3.767607 -1.903553
H 5.251252 3.104210 -3.603610
H -6.602486 1.235673 -2.973196
H -7.707988 -0.267844 -3.045989


